Name: Name:3-(2,3-Dimethoxyphenyl)propanoic acid
Brand: Angene
SKU: AG003HZT
Rating: 90 (10 reviews)

3-(2,3-Dimethoxyphenyl)propanoic acid

CAS No.:

10538-48-4

Catalog Number:

AG003HZT

Molecular Formula:

C11H14O4

Molecular Weight:

210.2265

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Product Description

Catalog Number:

AG003HZT

Chemical Name:

3-(2,3-Dimethoxyphenyl)propanoic acid

CAS Number:

10538-48-4

Molecular Formula:

C11H14O4

Molecular Weight:

210.2265

MDL Number:

MFCD00029821

IUPAC Name:

3-(2,3-dimethoxyphenyl)propanoic acid

InChI:

InChI=1S/C11H14O4/c1-14-9-5-3-4-8(11(9)15-2)6-7-10(12)13/h3-5H,6-7H2,1-2H3,(H,12,13)

InChI Key:

QPHAUUNQQLRYCJ-UHFFFAOYSA-N

SMILES:

COc1c(CCC(=O)O)cccc1OC

NSC Number:

235796

Properties

Complexity:

205

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

210.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

210.229g/mol

Monoisotopic Mass:

210.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Properties